5-(methoxymethyl)-N-[[2-[(3S)-3-oxidanylpiperidin-1-yl]pyridin-1-ium-3-yl]methyl]furan-2-carboxamide

Systemtic Name: 5-(methoxymethyl)-N-[[2-[(3S)-3-oxidanylpiperidin-1-yl]pyridin-1-ium-3-yl]methyl]furan-2-carboxamide Openeye Name: N-[[2-[(3S)-3-hydroxy-1-piperidyl]pyridin-1-ium-3-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide CAS Name: N-[[2-[(3S)-3-hydroxy-1-piperidinyl]-3-pyridin-1-iumyl]methyl]-5-(methoxymethyl)-2-furancarboxamide IUPAC Name: N-[[2-[(3S)-3-hydroxypiperidin-1-yl]pyridin-1-ium-3-yl]methyl]-5-(methoxymethyl)furan-2-carboxamide Traditional Name: N-[[2-[(3S)-3-hydroxypiperidino]pyridin-1-ium-3-yl]methyl]-5-(methoxymethyl)-2-furamide Formula: C18H24N3O4+ MolecularWeight: 346.40086

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=CC=C(O1)C(=O)NCC2=C([NH+]=CC=C2)N3CCCC(C3)O

Isomeric SMILES

COCC1=CC=C(O1)C(=O)NCC2=C([NH+]=CC=C2)N3CCC[C@@H](C3)O

InChI

InChI=1S/C18H23N3O4/c1-24-12-15-6-7-16(25-15)18(23)20-10-13-4-2-8-19-17(13)21-9-3-5-14(22)11-21/h2,4,6-8,14,22H,3,5,9-12H2,1H3,(H,20,23)/p+1/t14-/m0/s1